Geometry & MOs

Info

ID:	285454
PubChem CID:	104105718
Reduced:	NO2C17H29 (1)
Stoich.:	AB2C17D29 (1)
Weight, g/mol:	255.158292
ΔH_f, kcal/mol:	-107.7
Dipole, Da:	1.26
IP(EA), eV:	-8.6(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-hydroxypentan-2-ylamino)methyl]-1,3-dimethylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)CCOC1=CC=C(C=C1)CNC(C)CC(C)O

DOS

IR

Vibrations